1,4,7-Trioxa-10,13-diazacyclopentadecane
Basic information
- CAS
60350-17-6- Standard SMILES
C1CNCCOCCOCCOCCN1- InChIKey
HVPIIRJYGHPRDH-UHFFFAOYSA-N- Molecular formula
- C10H22N2O3
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.16304257
Names & identifiers
- Preferred name
- 1,4,7-Trioxa-10,13-diazacyclopentadecane
- IUPAC
- 1,4,7-trioxa-10,13-diazacyclopentadecane
Names & synonyms
1,4,7-trioxa-10,13-diazacyclopentadecane60350-17-6DTXSID50443089RefChem:219930DTXCID10393910SCHEMBL10702835
Database identifiers
- CAS
60350-17-6- PubChem CID
- 10656458
- DTXSID
DTXSID50443089
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 122
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Compound notes
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